SCHEMBL29989368

SCHEMBL29989368

Nc1ccc2c(c1)COCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
LMNA P02545 4/20 0.40
GAA P10253 4/20 0.40
CA9 Q16790 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
KDM4E B2RXH2 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GRIN2B Q13224 1/20 0.35
PIK3CD O00329 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6291296 1.00 MAPT (0.40) MAPTLMNAGAACA9CA12
SCHEMBL3982958 0.92 MAPT (0.40) MAPTLMNAGAACA9CA12
SCHEMBL2061060 0.87 MAPT (0.44) MAPTLMNAGAACA9CA12
SCHEMBL24820922 0.85 MAPT (0.47) MAPTLMNAGAACA9CA12
SCHEMBL892296 0.82 MAPT (0.45) MAPTLMNAGAACA9CA12
SCHEMBL29909954 0.82 MAPT (0.45) MAPTLMNAGAACA9CA12
SCHEMBL8237889 0.75 PIK3CD (0.36) MAPTGAAKDM4ESMN1; SMN2RAB9A
SCHEMBL19023151 0.75 DRD2 (0.43) CA2
SCHEMBL9122886 0.75 CA1 (0.39) CA1CA2RAB9ANPC1KMT2A
SCHEMBL4523516 0.75 PNMT (0.46) MAPTLMNAPIK3CDHSD17B3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208934-A1 ULK1/2 INHIBITORS AND THEIR USE THEREOF LIFEARC (GB) 2024-06-27 US disclosed
US-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. 2024-02-22 US disclosed
EP-4320121-A2 2,4-DIAMINOPYRIMIDINE DERIVATIVES AS ULK1/2 INHIBITORS AND THEIR USE THEREOF LifeArc (GB) 2024-02-14 EP disclosed
WO-2022214869-A2 ULK1/2 INHIBITORS AND THEIR USE THEREOF LIFEARC (GB) 2022-10-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240208934-A1 ULK1/2 INHIBITORS AND THEIR USE THEREOF ULK1, ULK2, ULK3 MAPT 717/4885LMNA 3488/4885GAA 1792/4885
US-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE KRAS, HRAS, APC MAPT 4629/4885LMNA 2007/4885GAA 2619/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.